2-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-4-(trifluoromethylsulfanyl)benzamide

Systemtic Name: 2-[[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]amino]-4-(trifluoromethylsulfanyl)benzamide Openeye Name: 2-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-4-(trifluoromethylsulfanyl)benzamide CAS Name: 2-[3-(4-bromo-1-methyl-3-pyrazolyl)anilino]-4-(trifluoromethylthio)benzamide IUPAC Name: 2-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-4-(trifluoromethylsulfanyl)benzamide Traditional Name: 2-[3-(4-bromo-1-methyl-pyrazol-3-yl)anilino]-4-(trifluoromethylthio)benzamide Formula: C18H14BrF3N4OS MolecularWeight: 471.29417

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)NC3=C(C=CC(=C3)SC(F)(F)F)C(=O)N)Br

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)NC3=C(C=CC(=C3)SC(F)(F)F)C(=O)N)Br

InChI

InChI=1S/C18H14BrF3N4OS/c1-26-9-14(19)16(25-26)10-3-2-4-11(7-10)24-15-8-12(28-18(20,21)22)5-6-13(15)17(23)27/h2-9,24H,1H3,(H2,23,27)